Compound Identification
SMILES
CN(C[C@@H](CCN1CCC(CC1)N1CCCCC1=O)C1=CC(Cl)=C(Cl)C=C1)C(=O)C1=CC(F)=CC=C1
InChIKey
InChIKey=ONVSREMZMCCOQT-JOCHJYFZSA-N
Formula
C28H34Cl2FN3O2
Mass
534.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Halobenzoic acids and derivatives
Direct Parent
3-halobenzoic acids and derivatives
Alternative Parents
Benzamides Dichlorobenzenes Benzoyl derivatives Piperidinones Aralkylamines Fluorobenzenes Delta lactams Aryl chlorides Aryl fluorides Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Azacyclic compounds Organofluorides Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-halobenzoic acid or derivatives - Benzamide - 1,2-dichlorobenzene - Benzoyl - Delta-lactam - Fluorobenzene - Halobenzene - Chlorobenzene - Piperidinone - Aralkylamine - Piperidine - Aryl fluoride - Aryl chloride - Aryl halide - Tertiary carboxylic acid amide - Tertiary amine - Lactam - Carboxamide group - Tertiary aliphatic amine - Amino acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Amine - Organohalogen compound - Organochloride - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 3-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 3-position of the benzene ring.
External Descriptors
Not available